3,4-dihydro-1H-isoquinolin-2-yl-[6-(3-phenylpiperazin-1-yl)pyridin-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[6-(3-phenylpiperazin-1-yl)pyridin-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[6-(3-phenylpiperazin-1-yl)-3-pyridyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[6-(3-phenyl-1-piperazinyl)-3-pyridinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[6-(3-phenylpiperazin-1-yl)pyridin-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[6-(3-phenylpiperazino)-3-pyridyl]methanone Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CN=C(C=C3)N4CCNC(C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CN=C(C=C3)N4CCNC(C4)C5=CC=CC=C5

InChI

InChI=1S/C25H26N4O/c30-25(29-14-12-19-6-4-5-9-22(19)17-29)21-10-11-24(27-16-21)28-15-13-26-23(18-28)20-7-2-1-3-8-20/h1-11,16,23,26H,12-15,17-18H2